3-butyl-7-[(4-chlorophenyl)methoxy]-8-ethanoyl-4-methyl-chromen-2-one

Systemtic Name: 3-butyl-7-[(4-chlorophenyl)methoxy]-8-ethanoyl-4-methyl-chromen-2-one Openeye Name: 8-acetyl-3-butyl-7-[(4-chlorophenyl)methoxy]-4-methyl-chromen-2-one CAS Name: 8-acetyl-3-butyl-7-[(4-chlorophenyl)methoxy]-4-methyl-1-benzopyran-2-one IUPAC Name: 8-acetyl-3-butyl-7-[(4-chlorophenyl)methoxy]-4-methylchromen-2-one Traditional Name: 8-acetyl-3-butyl-7-(4-chlorobenzyl)oxy-4-methyl-coumarin Formula: C23H23ClO4 MolecularWeight: 398.87932

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=C(C(=C(C=C2)OCC3=CC=C(C=C3)Cl)C(=O)C)OC1=O)C

Isomeric SMILES

CCCCC1=C(C2=C(C(=C(C=C2)OCC3=CC=C(C=C3)Cl)C(=O)C)OC1=O)C

InChI

InChI=1S/C23H23ClO4/c1-4-5-6-19-14(2)18-11-12-20(21(15(3)25)22(18)28-23(19)26)27-13-16-7-9-17(24)10-8-16/h7-12H,4-6,13H2,1-3H3